USER MOD reduce.3.24.130724 H: found=0, std=0, add=444, rem=0, adj=6 USER MOD reduce.3.24.130724 removed 444 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 52 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 SER OG : rot 180:sc= 0 USER MOD Single : A 56 SER OG : rot -41:sc= 1.15 USER MOD Single : B 152 THR OG1 : rot 180:sc= 0 USER MOD Single : B 153 SER OG : rot 180:sc= 0 USER MOD Single : B 156 SER OG : rot -39:sc= 1.02 USER MOD Single : B 176 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 120 N PRO A 50 2.582 21.978 -4.980 1.00 64.54 N ATOM 121 CA PRO A 50 1.588 21.077 -5.569 1.00 1.12 C ATOM 122 C PRO A 50 2.223 19.837 -6.188 1.00 70.34 C ATOM 123 O PRO A 50 1.722 18.723 -6.027 1.00 53.25 O ATOM 124 CB PRO A 50 0.927 21.936 -6.650 1.00 42.23 C ATOM 125 CG PRO A 50 1.956 22.952 -7.009 1.00 24.42 C ATOM 126 CD PRO A 50 2.723 23.228 -5.744 1.00 14.10 C ATOM 0 HA PRO A 50 0.891 20.696 -4.823 1.00 1.12 H new ATOM 0 HB2 PRO A 50 0.645 21.336 -7.515 1.00 42.23 H new ATOM 0 HB3 PRO A 50 0.017 22.408 -6.279 1.00 42.23 H new ATOM 0 HG2 PRO A 50 2.616 22.579 -7.792 1.00 24.42 H new ATOM 0 HG3 PRO A 50 1.491 23.861 -7.390 1.00 24.42 H new ATOM 0 HD2 PRO A 50 3.769 23.457 -5.950 1.00 14.10 H new ATOM 0 HD3 PRO A 50 2.311 24.079 -5.202 1.00 14.10 H new ATOM 134 N LEU A 51 3.328 20.036 -6.897 1.00 71.13 N ATOM 135 CA LEU A 51 4.034 18.934 -7.542 1.00 25.34 C ATOM 136 C LEU A 51 4.336 17.822 -6.542 1.00 43.42 C ATOM 137 O LEU A 51 4.411 16.648 -6.905 1.00 30.43 O ATOM 138 CB LEU A 51 5.334 19.434 -8.173 1.00 32.05 C ATOM 139 CG LEU A 51 5.193 20.173 -9.504 1.00 0.04 C ATOM 140 CD1 LEU A 51 6.434 21.005 -9.788 1.00 44.43 C ATOM 141 CD2 LEU A 51 4.939 19.188 -10.637 1.00 54.33 C ATOM 0 H LEU A 51 3.755 20.951 -7.040 1.00 71.13 H new ATOM 0 HA LEU A 51 3.390 18.531 -8.324 1.00 25.34 H new ATOM 0 HB2 LEU A 51 5.828 20.097 -7.463 1.00 32.05 H new ATOM 0 HB3 LEU A 51 5.994 18.579 -8.323 1.00 32.05 H new ATOM 0 HG LEU A 51 4.338 20.846 -9.434 1.00 0.04 H new ATOM 0 HD11 LEU A 51 6.315 21.523 -10.739 1.00 44.43 H new ATOM 0 HD12 LEU A 51 6.572 21.736 -8.991 1.00 44.43 H new ATOM 0 HD13 LEU A 51 7.306 20.353 -9.837 1.00 44.43 H new ATOM 0 HD21 LEU A 51 4.841 19.732 -11.577 1.00 54.33 H new ATOM 0 HD22 LEU A 51 5.774 18.490 -10.707 1.00 54.33 H new ATOM 0 HD23 LEU A 51 4.020 18.636 -10.440 1.00 54.33 H new ATOM 153 N THR A 52 4.504 18.199 -5.278 1.00 60.24 N ATOM 154 CA THR A 52 4.797 17.236 -4.225 1.00 24.40 C ATOM 155 C THR A 52 3.653 16.242 -4.056 1.00 0.22 C ATOM 156 O THR A 52 3.873 15.080 -3.717 1.00 63.11 O ATOM 157 CB THR A 52 5.056 17.937 -2.878 1.00 21.42 C ATOM 158 OG1 THR A 52 5.946 19.042 -3.064 1.00 52.13 O ATOM 159 CG2 THR A 52 5.651 16.966 -1.868 1.00 32.34 C ATOM 0 H THR A 52 4.442 19.166 -4.959 1.00 60.24 H new ATOM 0 HA THR A 52 5.698 16.702 -4.527 1.00 24.40 H new ATOM 0 HB THR A 52 4.103 18.299 -2.493 1.00 21.42 H new ATOM 0 HG1 THR A 52 6.104 19.483 -2.203 1.00 52.13 H new ATOM 0 HG21 THR A 52 5.825 17.484 -0.925 1.00 32.34 H new ATOM 0 HG22 THR A 52 4.959 16.140 -1.706 1.00 32.34 H new ATOM 0 HG23 THR A 52 6.596 16.578 -2.249 1.00 32.34 H new ATOM 167 N SER A 53 2.431 16.708 -4.296 1.00 23.22 N ATOM 168 CA SER A 53 1.252 15.859 -4.167 1.00 54.22 C ATOM 169 C SER A 53 1.234 14.785 -5.250 1.00 54.41 C ATOM 170 O SER A 53 1.195 13.591 -4.953 1.00 74.41 O ATOM 171 CB SER A 53 -0.021 16.705 -4.251 1.00 4.33 C ATOM 172 OG SER A 53 -0.702 16.725 -3.008 1.00 3.53 O ATOM 0 H SER A 53 2.232 17.667 -4.580 1.00 23.22 H new ATOM 0 HA SER A 53 1.292 15.368 -3.195 1.00 54.22 H new ATOM 0 HB2 SER A 53 0.234 17.723 -4.546 1.00 4.33 H new ATOM 0 HB3 SER A 53 -0.678 16.304 -5.023 1.00 4.33 H new ATOM 0 HG SER A 53 -1.511 17.273 -3.087 1.00 3.53 H new ATOM 178 N ILE A 54 1.262 15.219 -6.505 1.00 72.32 N ATOM 179 CA ILE A 54 1.251 14.295 -7.633 1.00 44.23 C ATOM 180 C ILE A 54 2.330 13.229 -7.481 1.00 31.21 C ATOM 181 O ILE A 54 2.084 12.044 -7.710 1.00 51.25 O ATOM 182 CB ILE A 54 1.458 15.034 -8.968 1.00 72.14 C ATOM 183 CG1 ILE A 54 0.388 16.112 -9.151 1.00 14.10 C ATOM 184 CG2 ILE A 54 1.430 14.050 -10.128 1.00 12.14 C ATOM 185 CD1 ILE A 54 -1.025 15.572 -9.133 1.00 25.41 C ATOM 0 H ILE A 54 1.292 16.204 -6.767 1.00 72.32 H new ATOM 0 HA ILE A 54 0.271 13.817 -7.640 1.00 44.23 H new ATOM 0 HB ILE A 54 2.435 15.518 -8.951 1.00 72.14 H new ATOM 0 HG12 ILE A 54 0.494 16.855 -8.361 1.00 14.10 H new ATOM 0 HG13 ILE A 54 0.560 16.626 -10.097 1.00 14.10 H new ATOM 0 HG21 ILE A 54 1.578 14.587 -11.065 1.00 12.14 H new ATOM 0 HG22 ILE A 54 2.226 13.316 -10.002 1.00 12.14 H new ATOM 0 HG23 ILE A 54 0.467 13.541 -10.150 1.00 12.14 H new ATOM 0 HD11 ILE A 54 -1.730 16.392 -9.268 1.00 25.41 H new ATOM 0 HD12 ILE A 54 -1.149 14.850 -9.940 1.00 25.41 H new ATOM 0 HD13 ILE A 54 -1.216 15.084 -8.177 1.00 25.41 H new ATOM 197 N ILE A 55 3.526 13.658 -7.093 1.00 71.45 N ATOM 198 CA ILE A 55 4.643 12.740 -6.907 1.00 34.51 C ATOM 199 C ILE A 55 4.395 11.802 -5.730 1.00 14.31 C ATOM 200 O ILE A 55 4.627 10.597 -5.824 1.00 72.20 O ATOM 201 CB ILE A 55 5.963 13.498 -6.675 1.00 51.13 C ATOM 202 CG1 ILE A 55 6.258 14.427 -7.855 1.00 41.22 C ATOM 203 CG2 ILE A 55 7.108 12.518 -6.467 1.00 62.33 C ATOM 204 CD1 ILE A 55 7.312 15.469 -7.554 1.00 34.42 C ATOM 0 H ILE A 55 3.747 14.635 -6.901 1.00 71.45 H new ATOM 0 HA ILE A 55 4.725 12.155 -7.823 1.00 34.51 H new ATOM 0 HB ILE A 55 5.862 14.105 -5.775 1.00 51.13 H new ATOM 0 HG12 ILE A 55 6.583 13.828 -8.706 1.00 41.22 H new ATOM 0 HG13 ILE A 55 5.337 14.929 -8.151 1.00 41.22 H new ATOM 0 HG21 ILE A 55 8.034 13.070 -6.304 1.00 62.33 H new ATOM 0 HG22 ILE A 55 6.900 11.894 -5.598 1.00 62.33 H new ATOM 0 HG23 ILE A 55 7.212 11.887 -7.350 1.00 62.33 H new ATOM 0 HD11 ILE A 55 7.470 16.092 -8.435 1.00 34.42 H new ATOM 0 HD12 ILE A 55 6.981 16.092 -6.723 1.00 34.42 H new ATOM 0 HD13 ILE A 55 8.246 14.975 -7.287 1.00 34.42 H new ATOM 216 N SER A 56 3.920 12.364 -4.624 1.00 4.55 N ATOM 217 CA SER A 56 3.641 11.579 -3.427 1.00 3.45 C ATOM 218 C SER A 56 2.578 10.520 -3.707 1.00 22.25 C ATOM 219 O SER A 56 2.689 9.380 -3.258 1.00 31.03 O ATOM 220 CB SER A 56 3.180 12.491 -2.289 1.00 51.01 C ATOM 221 OG SER A 56 1.865 12.968 -2.517 1.00 30.20 O ATOM 0 H SER A 56 3.720 13.360 -4.531 1.00 4.55 H new ATOM 0 HA SER A 56 4.561 11.076 -3.130 1.00 3.45 H new ATOM 0 HB2 SER A 56 3.214 11.946 -1.346 1.00 51.01 H new ATOM 0 HB3 SER A 56 3.865 13.334 -2.195 1.00 51.01 H new ATOM 0 HG SER A 56 1.764 13.209 -3.461 1.00 30.20 H new ATOM 227 N ALA A 57 1.548 10.907 -4.453 1.00 45.40 N ATOM 228 CA ALA A 57 0.467 9.992 -4.796 1.00 40.41 C ATOM 229 C ALA A 57 0.973 8.841 -5.658 1.00 74.31 C ATOM 230 O ALA A 57 0.677 7.677 -5.393 1.00 24.32 O ATOM 231 CB ALA A 57 -0.650 10.739 -5.510 1.00 74.11 C ATOM 0 H ALA A 57 1.440 11.848 -4.831 1.00 45.40 H new ATOM 0 HA ALA A 57 0.074 9.571 -3.871 1.00 40.41 H new ATOM 0 HB1 ALA A 57 -1.451 10.043 -5.760 1.00 74.11 H new ATOM 0 HB2 ALA A 57 -1.039 11.521 -4.858 1.00 74.11 H new ATOM 0 HB3 ALA A 57 -0.261 11.188 -6.424 1.00 74.11 H new ATOM 237 N VAL A 58 1.738 9.175 -6.692 1.00 14.21 N ATOM 238 CA VAL A 58 2.286 8.169 -7.595 1.00 51.34 C ATOM 239 C VAL A 58 3.070 7.111 -6.827 1.00 44.33 C ATOM 240 O VAL A 58 2.924 5.914 -7.073 1.00 13.42 O ATOM 241 CB VAL A 58 3.206 8.807 -8.653 1.00 61.41 C ATOM 242 CG1 VAL A 58 3.840 7.734 -9.525 1.00 23.43 C ATOM 243 CG2 VAL A 58 2.432 9.804 -9.501 1.00 43.14 C ATOM 0 H VAL A 58 1.993 10.135 -6.926 1.00 14.21 H new ATOM 0 HA VAL A 58 1.440 7.698 -8.096 1.00 51.34 H new ATOM 0 HB VAL A 58 4.004 9.344 -8.139 1.00 61.41 H new ATOM 0 HG11 VAL A 58 4.487 8.203 -10.267 1.00 23.43 H new ATOM 0 HG12 VAL A 58 4.430 7.061 -8.903 1.00 23.43 H new ATOM 0 HG13 VAL A 58 3.058 7.168 -10.031 1.00 23.43 H new ATOM 0 HG21 VAL A 58 3.098 10.245 -10.243 1.00 43.14 H new ATOM 0 HG22 VAL A 58 1.613 9.293 -10.007 1.00 43.14 H new ATOM 0 HG23 VAL A 58 2.030 10.590 -8.862 1.00 43.14 H new ATOM 253 N VAL A 59 3.902 7.560 -5.893 1.00 54.44 N ATOM 254 CA VAL A 59 4.709 6.653 -5.086 1.00 1.42 C ATOM 255 C VAL A 59 3.828 5.696 -4.290 1.00 53.32 C ATOM 256 O VAL A 59 4.057 4.488 -4.281 1.00 10.13 O ATOM 257 CB VAL A 59 5.620 7.424 -4.114 1.00 51.14 C ATOM 258 CG1 VAL A 59 6.393 6.461 -3.227 1.00 22.13 C ATOM 259 CG2 VAL A 59 6.568 8.333 -4.881 1.00 74.53 C ATOM 0 H VAL A 59 4.035 8.548 -5.676 1.00 54.44 H new ATOM 0 HA VAL A 59 5.330 6.082 -5.777 1.00 1.42 H new ATOM 0 HB VAL A 59 4.994 8.046 -3.474 1.00 51.14 H new ATOM 0 HG11 VAL A 59 7.031 7.025 -2.547 1.00 22.13 H new ATOM 0 HG12 VAL A 59 5.693 5.856 -2.650 1.00 22.13 H new ATOM 0 HG13 VAL A 59 7.009 5.810 -3.847 1.00 22.13 H new ATOM 0 HG21 VAL A 59 7.205 8.871 -4.178 1.00 74.53 H new ATOM 0 HG22 VAL A 59 7.188 7.733 -5.547 1.00 74.53 H new ATOM 0 HG23 VAL A 59 5.991 9.048 -5.468 1.00 74.53 H new ATOM 269 N GLY A 60 2.819 6.247 -3.621 1.00 74.24 N ATOM 270 CA GLY A 60 1.919 5.428 -2.830 1.00 55.41 C ATOM 271 C GLY A 60 1.168 4.415 -3.670 1.00 15.23 C ATOM 272 O GLY A 60 1.093 3.238 -3.315 1.00 12.50 O ATOM 0 H GLY A 60 2.609 7.245 -3.613 1.00 74.24 H new ATOM 0 HA2 GLY A 60 2.489 4.907 -2.061 1.00 55.41 H new ATOM 0 HA3 GLY A 60 1.204 6.071 -2.317 1.00 55.41 H new ATOM 276 N ILE A 61 0.610 4.872 -4.787 1.00 24.04 N ATOM 277 CA ILE A 61 -0.139 3.995 -5.679 1.00 55.22 C ATOM 278 C ILE A 61 0.769 2.942 -6.305 1.00 10.43 C ATOM 279 O ILE A 61 0.332 1.830 -6.605 1.00 33.05 O ATOM 280 CB ILE A 61 -0.831 4.793 -6.800 1.00 75.22 C ATOM 281 CG1 ILE A 61 -1.780 5.834 -6.205 1.00 54.24 C ATOM 282 CG2 ILE A 61 -1.583 3.854 -7.732 1.00 60.21 C ATOM 283 CD1 ILE A 61 -2.350 6.788 -7.230 1.00 54.54 C ATOM 0 H ILE A 61 0.662 5.843 -5.095 1.00 24.04 H new ATOM 0 HA ILE A 61 -0.899 3.501 -5.073 1.00 55.22 H new ATOM 0 HB ILE A 61 -0.068 5.314 -7.378 1.00 75.22 H new ATOM 0 HG12 ILE A 61 -2.600 5.321 -5.703 1.00 54.24 H new ATOM 0 HG13 ILE A 61 -1.248 6.406 -5.445 1.00 54.24 H new ATOM 0 HG21 ILE A 61 -2.067 4.433 -8.519 1.00 60.21 H new ATOM 0 HG22 ILE A 61 -0.883 3.148 -8.179 1.00 60.21 H new ATOM 0 HG23 ILE A 61 -2.338 3.308 -7.167 1.00 60.21 H new ATOM 0 HD11 ILE A 61 -3.014 7.498 -6.737 1.00 54.54 H new ATOM 0 HD12 ILE A 61 -1.537 7.328 -7.716 1.00 54.54 H new ATOM 0 HD13 ILE A 61 -2.910 6.227 -7.978 1.00 54.54 H new ATOM 295 N LEU A 62 2.034 3.299 -6.498 1.00 0.04 N ATOM 296 CA LEU A 62 3.005 2.383 -7.086 1.00 15.14 C ATOM 297 C LEU A 62 3.340 1.250 -6.122 1.00 31.21 C ATOM 298 O LEU A 62 3.384 0.082 -6.511 1.00 63.14 O ATOM 299 CB LEU A 62 4.280 3.137 -7.468 1.00 1.13 C ATOM 300 CG LEU A 62 5.329 2.335 -8.238 1.00 60.42 C ATOM 301 CD1 LEU A 62 5.590 2.965 -9.598 1.00 63.31 C ATOM 302 CD2 LEU A 62 6.620 2.237 -7.438 1.00 1.24 C ATOM 0 H LEU A 62 2.411 4.215 -6.256 1.00 0.04 H new ATOM 0 HA LEU A 62 2.562 1.951 -7.984 1.00 15.14 H new ATOM 0 HB2 LEU A 62 4.000 4.002 -8.069 1.00 1.13 H new ATOM 0 HB3 LEU A 62 4.740 3.518 -6.556 1.00 1.13 H new ATOM 0 HG LEU A 62 4.945 1.327 -8.394 1.00 60.42 H new ATOM 0 HD11 LEU A 62 6.339 2.381 -10.132 1.00 63.31 H new ATOM 0 HD12 LEU A 62 4.665 2.982 -10.174 1.00 63.31 H new ATOM 0 HD13 LEU A 62 5.953 3.984 -9.463 1.00 63.31 H new ATOM 0 HD21 LEU A 62 7.355 1.663 -8.002 1.00 1.24 H new ATOM 0 HD22 LEU A 62 7.008 3.238 -7.250 1.00 1.24 H new ATOM 0 HD23 LEU A 62 6.423 1.740 -6.488 1.00 1.24 H new ATOM 314 N LEU A 63 3.572 1.602 -4.862 1.00 12.21 N ATOM 315 CA LEU A 63 3.900 0.614 -3.840 1.00 32.31 C ATOM 316 C LEU A 63 2.733 -0.341 -3.611 1.00 1.30 C ATOM 317 O LEU A 63 2.929 -1.537 -3.391 1.00 41.53 O ATOM 318 CB LEU A 63 4.269 1.311 -2.530 1.00 4.50 C ATOM 319 CG LEU A 63 5.356 0.636 -1.693 1.00 65.41 C ATOM 320 CD1 LEU A 63 6.722 0.840 -2.329 1.00 24.54 C ATOM 321 CD2 LEU A 63 5.344 1.172 -0.269 1.00 3.24 C ATOM 0 H LEU A 63 3.539 2.564 -4.524 1.00 12.21 H new ATOM 0 HA LEU A 63 4.755 0.035 -4.190 1.00 32.31 H new ATOM 0 HB2 LEU A 63 4.594 2.326 -2.761 1.00 4.50 H new ATOM 0 HB3 LEU A 63 3.369 1.395 -1.921 1.00 4.50 H new ATOM 0 HG LEU A 63 5.149 -0.434 -1.659 1.00 65.41 H new ATOM 0 HD11 LEU A 63 7.483 0.353 -1.720 1.00 24.54 H new ATOM 0 HD12 LEU A 63 6.726 0.407 -3.329 1.00 24.54 H new ATOM 0 HD13 LEU A 63 6.937 1.907 -2.394 1.00 24.54 H new ATOM 0 HD21 LEU A 63 6.124 0.680 0.312 1.00 3.24 H new ATOM 0 HD22 LEU A 63 5.525 2.247 -0.283 1.00 3.24 H new ATOM 0 HD23 LEU A 63 4.374 0.974 0.186 1.00 3.24 H new ATOM 333 N VAL A 64 1.518 0.194 -3.665 1.00 55.51 N ATOM 334 CA VAL A 64 0.318 -0.611 -3.468 1.00 45.05 C ATOM 335 C VAL A 64 0.186 -1.676 -4.550 1.00 60.32 C ATOM 336 O VAL A 64 0.104 -2.868 -4.255 1.00 31.45 O ATOM 337 CB VAL A 64 -0.950 0.263 -3.466 1.00 41.22 C ATOM 338 CG1 VAL A 64 -2.192 -0.598 -3.292 1.00 20.22 C ATOM 339 CG2 VAL A 64 -0.867 1.320 -2.375 1.00 44.53 C ATOM 0 H VAL A 64 1.338 1.182 -3.844 1.00 55.51 H new ATOM 0 HA VAL A 64 0.418 -1.095 -2.497 1.00 45.05 H new ATOM 0 HB VAL A 64 -1.021 0.771 -4.428 1.00 41.22 H new ATOM 0 HG11 VAL A 64 -3.078 0.037 -3.293 1.00 20.22 H new ATOM 0 HG12 VAL A 64 -2.257 -1.313 -4.112 1.00 20.22 H new ATOM 0 HG13 VAL A 64 -2.132 -1.136 -2.346 1.00 20.22 H new ATOM 0 HG21 VAL A 64 -1.771 1.928 -2.388 1.00 44.53 H new ATOM 0 HG22 VAL A 64 -0.771 0.834 -1.404 1.00 44.53 H new ATOM 0 HG23 VAL A 64 0.001 1.956 -2.550 1.00 44.53 H new ATOM 349 N VAL A 65 0.168 -1.239 -5.805 1.00 41.51 N ATOM 350 CA VAL A 65 0.048 -2.155 -6.933 1.00 44.51 C ATOM 351 C VAL A 65 1.089 -3.265 -6.852 1.00 62.34 C ATOM 352 O VAL A 65 0.764 -4.447 -6.965 1.00 13.21 O ATOM 353 CB VAL A 65 0.203 -1.416 -8.274 1.00 74.22 C ATOM 354 CG1 VAL A 65 0.100 -2.392 -9.437 1.00 62.30 C ATOM 355 CG2 VAL A 65 -0.839 -0.314 -8.400 1.00 63.23 C ATOM 0 H VAL A 65 0.235 -0.255 -6.066 1.00 41.51 H new ATOM 0 HA VAL A 65 -0.949 -2.592 -6.882 1.00 44.51 H new ATOM 0 HB VAL A 65 1.191 -0.956 -8.302 1.00 74.22 H new ATOM 0 HG11 VAL A 65 0.212 -1.851 -10.377 1.00 62.30 H new ATOM 0 HG12 VAL A 65 0.887 -3.142 -9.354 1.00 62.30 H new ATOM 0 HG13 VAL A 65 -0.873 -2.883 -9.415 1.00 62.30 H new ATOM 0 HG21 VAL A 65 -0.714 0.198 -9.354 1.00 63.23 H new ATOM 0 HG22 VAL A 65 -1.837 -0.749 -8.350 1.00 63.23 H new ATOM 0 HG23 VAL A 65 -0.713 0.400 -7.586 1.00 63.23 H new ATOM 365 N VAL A 66 2.346 -2.877 -6.655 1.00 13.32 N ATOM 366 CA VAL A 66 3.436 -3.839 -6.558 1.00 41.35 C ATOM 367 C VAL A 66 3.163 -4.872 -5.470 1.00 10.21 C ATOM 368 O VAL A 66 3.465 -6.055 -5.631 1.00 53.13 O ATOM 369 CB VAL A 66 4.776 -3.140 -6.261 1.00 32.22 C ATOM 370 CG1 VAL A 66 5.895 -4.163 -6.134 1.00 42.04 C ATOM 371 CG2 VAL A 66 5.096 -2.120 -7.343 1.00 22.25 C ATOM 0 H VAL A 66 2.633 -1.903 -6.560 1.00 13.32 H new ATOM 0 HA VAL A 66 3.502 -4.341 -7.523 1.00 41.35 H new ATOM 0 HB VAL A 66 4.688 -2.613 -5.311 1.00 32.22 H new ATOM 0 HG11 VAL A 66 6.834 -3.651 -5.924 1.00 42.04 H new ATOM 0 HG12 VAL A 66 5.668 -4.852 -5.320 1.00 42.04 H new ATOM 0 HG13 VAL A 66 5.986 -4.720 -7.066 1.00 42.04 H new ATOM 0 HG21 VAL A 66 6.046 -1.636 -7.117 1.00 22.25 H new ATOM 0 HG22 VAL A 66 5.165 -2.623 -8.308 1.00 22.25 H new ATOM 0 HG23 VAL A 66 4.306 -1.370 -7.381 1.00 22.25 H new ATOM 381 N LEU A 67 2.588 -4.417 -4.362 1.00 43.42 N ATOM 382 CA LEU A 67 2.272 -5.302 -3.245 1.00 54.14 C ATOM 383 C LEU A 67 1.227 -6.336 -3.649 1.00 14.23 C ATOM 384 O LEU A 67 1.402 -7.533 -3.419 1.00 14.21 O ATOM 385 CB LEU A 67 1.767 -4.489 -2.052 1.00 25.31 C ATOM 386 CG LEU A 67 2.089 -5.056 -0.669 1.00 4.33 C ATOM 387 CD1 LEU A 67 1.601 -6.492 -0.554 1.00 3.33 C ATOM 388 CD2 LEU A 67 3.583 -4.976 -0.394 1.00 64.41 C ATOM 0 H LEU A 67 2.331 -3.441 -4.213 1.00 43.42 H new ATOM 0 HA LEU A 67 3.184 -5.826 -2.960 1.00 54.14 H new ATOM 0 HB2 LEU A 67 2.187 -3.485 -2.118 1.00 25.31 H new ATOM 0 HB3 LEU A 67 0.685 -4.388 -2.138 1.00 25.31 H new ATOM 0 HG LEU A 67 1.570 -4.456 0.078 1.00 4.33 H new ATOM 0 HD11 LEU A 67 1.839 -6.879 0.437 1.00 3.33 H new ATOM 0 HD12 LEU A 67 0.522 -6.523 -0.706 1.00 3.33 H new ATOM 0 HD13 LEU A 67 2.092 -7.105 -1.310 1.00 3.33 H new ATOM 0 HD21 LEU A 67 3.793 -5.384 0.595 1.00 64.41 H new ATOM 0 HD22 LEU A 67 4.123 -5.551 -1.146 1.00 64.41 H new ATOM 0 HD23 LEU A 67 3.905 -3.935 -0.433 1.00 64.41 H new ATOM 400 N GLY A 68 0.140 -5.867 -4.255 1.00 62.53 N ATOM 401 CA GLY A 68 -0.917 -6.765 -4.683 1.00 73.15 C ATOM 402 C GLY A 68 -0.410 -7.858 -5.605 1.00 55.33 C ATOM 403 O GLY A 68 -0.763 -9.026 -5.446 1.00 71.43 O ATOM 0 H GLY A 68 -0.027 -4.881 -4.457 1.00 62.53 H new ATOM 0 HA2 GLY A 68 -1.381 -7.219 -3.807 1.00 73.15 H new ATOM 0 HA3 GLY A 68 -1.691 -6.193 -5.194 1.00 73.15 H new ATOM 407 N VAL A 69 0.416 -7.477 -6.573 1.00 71.31 N ATOM 408 CA VAL A 69 0.971 -8.432 -7.525 1.00 2.01 C ATOM 409 C VAL A 69 1.771 -9.517 -6.812 1.00 42.24 C ATOM 410 O VAL A 69 1.586 -10.707 -7.063 1.00 13.55 O ATOM 411 CB VAL A 69 1.879 -7.735 -8.556 1.00 1.55 C ATOM 412 CG1 VAL A 69 2.495 -8.756 -9.500 1.00 33.41 C ATOM 413 CG2 VAL A 69 1.096 -6.685 -9.329 1.00 10.33 C ATOM 0 H VAL A 69 0.716 -6.513 -6.719 1.00 71.31 H new ATOM 0 HA VAL A 69 0.127 -8.887 -8.044 1.00 2.01 H new ATOM 0 HB VAL A 69 2.688 -7.234 -8.024 1.00 1.55 H new ATOM 0 HG11 VAL A 69 3.133 -8.246 -10.221 1.00 33.41 H new ATOM 0 HG12 VAL A 69 3.091 -9.468 -8.928 1.00 33.41 H new ATOM 0 HG13 VAL A 69 1.703 -9.287 -10.028 1.00 33.41 H new ATOM 0 HG21 VAL A 69 1.752 -6.202 -10.053 1.00 10.33 H new ATOM 0 HG22 VAL A 69 0.267 -7.161 -9.852 1.00 10.33 H new ATOM 0 HG23 VAL A 69 0.707 -5.938 -8.637 1.00 10.33 H new ATOM 423 N VAL A 70 2.661 -9.096 -5.918 1.00 22.42 N ATOM 424 CA VAL A 70 3.489 -10.032 -5.167 1.00 65.25 C ATOM 425 C VAL A 70 2.632 -10.974 -4.328 1.00 25.00 C ATOM 426 O VAL A 70 2.760 -12.195 -4.421 1.00 42.22 O ATOM 427 CB VAL A 70 4.473 -9.292 -4.242 1.00 63.34 C ATOM 428 CG1 VAL A 70 5.387 -10.281 -3.533 1.00 44.53 C ATOM 429 CG2 VAL A 70 5.285 -8.277 -5.032 1.00 61.42 C ATOM 0 H VAL A 70 2.827 -8.114 -5.697 1.00 22.42 H new ATOM 0 HA VAL A 70 4.053 -10.612 -5.897 1.00 65.25 H new ATOM 0 HB VAL A 70 3.900 -8.756 -3.485 1.00 63.34 H new ATOM 0 HG11 VAL A 70 6.075 -9.740 -2.884 1.00 44.53 H new ATOM 0 HG12 VAL A 70 4.787 -10.966 -2.934 1.00 44.53 H new ATOM 0 HG13 VAL A 70 5.954 -10.846 -4.272 1.00 44.53 H new ATOM 0 HG21 VAL A 70 5.975 -7.763 -4.363 1.00 61.42 H new ATOM 0 HG22 VAL A 70 5.849 -8.790 -5.811 1.00 61.42 H new ATOM 0 HG23 VAL A 70 4.613 -7.550 -5.489 1.00 61.42 H new ATOM 439 N PHE A 71 1.757 -10.398 -3.510 1.00 53.21 N ATOM 440 CA PHE A 71 0.878 -11.186 -2.654 1.00 14.03 C ATOM 441 C PHE A 71 0.127 -12.237 -3.466 1.00 70.50 C ATOM 442 O PHE A 71 0.156 -13.424 -3.143 1.00 63.31 O ATOM 443 CB PHE A 71 -0.118 -10.275 -1.934 1.00 52.43 C ATOM 444 CG PHE A 71 -0.722 -10.898 -0.709 1.00 42.52 C ATOM 445 CD1 PHE A 71 0.083 -11.473 0.261 1.00 13.32 C ATOM 446 CD2 PHE A 71 -2.096 -10.907 -0.524 1.00 73.04 C ATOM 447 CE1 PHE A 71 -0.471 -12.048 1.390 1.00 74.12 C ATOM 448 CE2 PHE A 71 -2.655 -11.479 0.603 1.00 31.10 C ATOM 449 CZ PHE A 71 -1.841 -12.049 1.561 1.00 43.24 C ATOM 0 H PHE A 71 1.638 -9.389 -3.422 1.00 53.21 H new ATOM 0 HA PHE A 71 1.495 -11.696 -1.914 1.00 14.03 H new ATOM 0 HB2 PHE A 71 0.386 -9.351 -1.651 1.00 52.43 H new ATOM 0 HB3 PHE A 71 -0.916 -10.004 -2.625 1.00 52.43 H new ATOM 0 HD1 PHE A 71 1.155 -11.472 0.134 1.00 13.32 H new ATOM 0 HD2 PHE A 71 -2.737 -10.461 -1.270 1.00 73.04 H new ATOM 0 HE1 PHE A 71 0.167 -12.496 2.137 1.00 74.12 H new ATOM 0 HE2 PHE A 71 -3.727 -11.480 0.734 1.00 31.10 H new ATOM 0 HZ PHE A 71 -2.275 -12.495 2.443 1.00 43.24 H new ATOM 459 N GLY A 72 -0.544 -11.792 -4.523 1.00 52.50 N ATOM 460 CA GLY A 72 -1.294 -12.706 -5.365 1.00 13.11 C ATOM 461 C GLY A 72 -0.459 -13.883 -5.829 1.00 5.21 C ATOM 462 O GLY A 72 -0.811 -15.038 -5.580 1.00 61.45 O ATOM 0 H GLY A 72 -0.582 -10.814 -4.812 1.00 52.50 H new ATOM 0 HA2 GLY A 72 -2.161 -13.073 -4.816 1.00 13.11 H new ATOM 0 HA3 GLY A 72 -1.672 -12.168 -6.234 1.00 13.11 H new ATOM 466 N ILE A 73 0.647 -13.593 -6.506 1.00 3.30 N ATOM 467 CA ILE A 73 1.533 -14.637 -7.005 1.00 10.32 C ATOM 468 C ILE A 73 2.042 -15.516 -5.868 1.00 72.11 C ATOM 469 O ILE A 73 2.135 -16.737 -6.005 1.00 14.45 O ATOM 470 CB ILE A 73 2.736 -14.041 -7.757 1.00 30.40 C ATOM 471 CG1 ILE A 73 2.259 -13.183 -8.930 1.00 35.13 C ATOM 472 CG2 ILE A 73 3.658 -15.149 -8.245 1.00 65.13 C ATOM 473 CD1 ILE A 73 3.343 -12.307 -9.520 1.00 3.54 C ATOM 0 H ILE A 73 0.951 -12.643 -6.721 1.00 3.30 H new ATOM 0 HA ILE A 73 0.948 -15.244 -7.696 1.00 10.32 H new ATOM 0 HB ILE A 73 3.295 -13.405 -7.070 1.00 30.40 H new ATOM 0 HG12 ILE A 73 1.866 -13.835 -9.710 1.00 35.13 H new ATOM 0 HG13 ILE A 73 1.435 -12.552 -8.596 1.00 35.13 H new ATOM 0 HG21 ILE A 73 4.504 -14.711 -8.775 1.00 65.13 H new ATOM 0 HG22 ILE A 73 4.021 -15.722 -7.392 1.00 65.13 H new ATOM 0 HG23 ILE A 73 3.110 -15.808 -8.918 1.00 65.13 H new ATOM 0 HD11 ILE A 73 2.933 -11.727 -10.347 1.00 3.54 H new ATOM 0 HD12 ILE A 73 3.721 -11.630 -8.754 1.00 3.54 H new ATOM 0 HD13 ILE A 73 4.158 -12.932 -9.885 1.00 3.54 H new ATOM 834 N PRO B 150 14.465 17.328 -2.366 1.00 33.24 N ATOM 835 CA PRO B 150 14.589 16.200 -1.440 1.00 62.40 C ATOM 836 C PRO B 150 13.350 16.025 -0.570 1.00 4.13 C ATOM 837 O PRO B 150 12.890 14.904 -0.344 1.00 42.23 O ATOM 838 CB PRO B 150 15.798 16.579 -0.579 1.00 3.51 C ATOM 839 CG PRO B 150 15.853 18.066 -0.639 1.00 52.44 C ATOM 840 CD PRO B 150 15.356 18.444 -2.007 1.00 40.24 C ATOM 0 HA PRO B 150 14.703 15.252 -1.966 1.00 62.40 H new ATOM 0 HB2 PRO B 150 15.680 16.228 0.446 1.00 3.51 H new ATOM 0 HB3 PRO B 150 16.715 16.133 -0.965 1.00 3.51 H new ATOM 0 HG2 PRO B 150 15.232 18.511 0.138 1.00 52.44 H new ATOM 0 HG3 PRO B 150 16.870 18.426 -0.480 1.00 52.44 H new ATOM 0 HD2 PRO B 150 14.823 19.395 -1.993 1.00 40.24 H new ATOM 0 HD3 PRO B 150 16.176 18.549 -2.718 1.00 40.24 H new ATOM 848 N LEU B 151 12.812 17.138 -0.084 1.00 44.40 N ATOM 849 CA LEU B 151 11.623 17.108 0.762 1.00 21.34 C ATOM 850 C LEU B 151 10.501 16.317 0.095 1.00 44.54 C ATOM 851 O LEU B 151 9.667 15.713 0.769 1.00 45.45 O ATOM 852 CB LEU B 151 11.151 18.532 1.063 1.00 22.34 C ATOM 853 CG LEU B 151 11.941 19.288 2.132 1.00 11.31 C ATOM 854 CD1 LEU B 151 11.698 20.785 2.016 1.00 14.25 C ATOM 855 CD2 LEU B 151 11.568 18.791 3.521 1.00 2.50 C ATOM 0 H LEU B 151 13.180 18.073 -0.261 1.00 44.40 H new ATOM 0 HA LEU B 151 11.884 16.614 1.698 1.00 21.34 H new ATOM 0 HB2 LEU B 151 11.186 19.108 0.138 1.00 22.34 H new ATOM 0 HB3 LEU B 151 10.107 18.490 1.373 1.00 22.34 H new ATOM 0 HG LEU B 151 13.003 19.100 1.974 1.00 11.31 H new ATOM 0 HD11 LEU B 151 12.268 21.307 2.785 1.00 14.25 H new ATOM 0 HD12 LEU B 151 12.015 21.130 1.032 1.00 14.25 H new ATOM 0 HD13 LEU B 151 10.636 20.993 2.148 1.00 14.25 H new ATOM 0 HD21 LEU B 151 12.140 19.340 4.269 1.00 2.50 H new ATOM 0 HD22 LEU B 151 10.503 18.949 3.690 1.00 2.50 H new ATOM 0 HD23 LEU B 151 11.794 17.728 3.600 1.00 2.50 H new ATOM 867 N THR B 152 10.487 16.326 -1.234 1.00 44.13 N ATOM 868 CA THR B 152 9.469 15.609 -1.991 1.00 12.42 C ATOM 869 C THR B 152 9.539 14.110 -1.727 1.00 62.21 C ATOM 870 O THR B 152 8.520 13.419 -1.740 1.00 71.33 O ATOM 871 CB THR B 152 9.615 15.859 -3.504 1.00 73.42 C ATOM 872 OG1 THR B 152 9.805 17.257 -3.754 1.00 31.12 O ATOM 873 CG2 THR B 152 8.387 15.367 -4.255 1.00 54.01 C ATOM 0 H THR B 152 11.169 16.822 -1.808 1.00 44.13 H new ATOM 0 HA THR B 152 8.503 15.988 -1.658 1.00 12.42 H new ATOM 0 HB THR B 152 10.484 15.305 -3.859 1.00 73.42 H new ATOM 0 HG1 THR B 152 9.899 17.407 -4.718 1.00 31.12 H new ATOM 0 HG21 THR B 152 8.513 15.554 -5.321 1.00 54.01 H new ATOM 0 HG22 THR B 152 8.262 14.297 -4.087 1.00 54.01 H new ATOM 0 HG23 THR B 152 7.504 15.896 -3.896 1.00 54.01 H new ATOM 881 N SER B 153 10.748 13.612 -1.485 1.00 52.33 N ATOM 882 CA SER B 153 10.951 12.193 -1.219 1.00 43.03 C ATOM 883 C SER B 153 10.337 11.798 0.120 1.00 2.23 C ATOM 884 O SER B 153 9.481 10.914 0.187 1.00 52.02 O ATOM 885 CB SER B 153 12.444 11.860 -1.227 1.00 10.25 C ATOM 886 OG SER B 153 12.776 11.034 -2.329 1.00 23.33 O ATOM 0 H SER B 153 11.601 14.171 -1.468 1.00 52.33 H new ATOM 0 HA SER B 153 10.455 11.626 -2.007 1.00 43.03 H new ATOM 0 HB2 SER B 153 13.025 12.781 -1.271 1.00 10.25 H new ATOM 0 HB3 SER B 153 12.713 11.358 -0.298 1.00 10.25 H new ATOM 0 HG SER B 153 13.736 10.837 -2.313 1.00 23.33 H new ATOM 892 N ILE B 154 10.780 12.458 1.185 1.00 20.24 N ATOM 893 CA ILE B 154 10.274 12.177 2.523 1.00 3.11 C ATOM 894 C ILE B 154 8.750 12.210 2.553 1.00 71.44 C ATOM 895 O ILE B 154 8.111 11.337 3.139 1.00 23.21 O ATOM 896 CB ILE B 154 10.819 13.183 3.553 1.00 41.22 C ATOM 897 CG1 ILE B 154 12.349 13.172 3.550 1.00 63.13 C ATOM 898 CG2 ILE B 154 10.285 12.861 4.941 1.00 45.43 C ATOM 899 CD1 ILE B 154 12.945 11.818 3.863 1.00 22.03 C ATOM 0 H ILE B 154 11.488 13.191 1.147 1.00 20.24 H new ATOM 0 HA ILE B 154 10.618 11.177 2.787 1.00 3.11 H new ATOM 0 HB ILE B 154 10.481 14.182 3.277 1.00 41.22 H new ATOM 0 HG12 ILE B 154 12.704 13.499 2.573 1.00 63.13 H new ATOM 0 HG13 ILE B 154 12.711 13.896 4.280 1.00 63.13 H new ATOM 0 HG21 ILE B 154 10.679 13.581 5.658 1.00 45.43 H new ATOM 0 HG22 ILE B 154 9.196 12.915 4.934 1.00 45.43 H new ATOM 0 HG23 ILE B 154 10.597 11.856 5.227 1.00 45.43 H new ATOM 0 HD11 ILE B 154 14.033 11.886 3.843 1.00 22.03 H new ATOM 0 HD12 ILE B 154 12.619 11.497 4.852 1.00 22.03 H new ATOM 0 HD13 ILE B 154 12.613 11.094 3.119 1.00 22.03 H new ATOM 911 N ILE B 155 8.174 13.224 1.916 1.00 12.14 N ATOM 912 CA ILE B 155 6.725 13.370 1.867 1.00 14.23 C ATOM 913 C ILE B 155 6.087 12.252 1.048 1.00 12.13 C ATOM 914 O ILE B 155 5.083 11.667 1.454 1.00 62.01 O ATOM 915 CB ILE B 155 6.315 14.727 1.267 1.00 74.22 C ATOM 916 CG1 ILE B 155 6.914 15.873 2.085 1.00 41.23 C ATOM 917 CG2 ILE B 155 4.799 14.846 1.209 1.00 53.21 C ATOM 918 CD1 ILE B 155 6.882 17.207 1.372 1.00 0.15 C ATOM 0 H ILE B 155 8.689 13.956 1.427 1.00 12.14 H new ATOM 0 HA ILE B 155 6.368 13.314 2.895 1.00 14.23 H new ATOM 0 HB ILE B 155 6.703 14.789 0.250 1.00 74.22 H new ATOM 0 HG12 ILE B 155 6.370 15.960 3.026 1.00 41.23 H new ATOM 0 HG13 ILE B 155 7.946 15.629 2.335 1.00 41.23 H new ATOM 0 HG21 ILE B 155 4.526 15.811 0.782 1.00 53.21 H new ATOM 0 HG22 ILE B 155 4.395 14.047 0.587 1.00 53.21 H new ATOM 0 HG23 ILE B 155 4.389 14.765 2.216 1.00 53.21 H new ATOM 0 HD11 ILE B 155 7.323 17.972 2.011 1.00 0.15 H new ATOM 0 HD12 ILE B 155 7.450 17.138 0.445 1.00 0.15 H new ATOM 0 HD13 ILE B 155 5.850 17.474 1.146 1.00 0.15 H new ATOM 930 N SER B 156 6.678 11.960 -0.106 1.00 2.12 N ATOM 931 CA SER B 156 6.167 10.913 -0.983 1.00 21.41 C ATOM 932 C SER B 156 6.189 9.558 -0.283 1.00 44.43 C ATOM 933 O SER B 156 5.246 8.775 -0.392 1.00 21.14 O ATOM 934 CB SER B 156 6.993 10.848 -2.269 1.00 13.03 C ATOM 935 OG SER B 156 8.271 10.287 -2.027 1.00 24.13 O ATOM 0 H SER B 156 7.511 12.434 -0.455 1.00 2.12 H new ATOM 0 HA SER B 156 5.134 11.156 -1.234 1.00 21.41 H new ATOM 0 HB2 SER B 156 6.466 10.252 -3.014 1.00 13.03 H new ATOM 0 HB3 SER B 156 7.105 11.850 -2.684 1.00 13.03 H new ATOM 0 HG SER B 156 8.610 10.605 -1.164 1.00 24.13 H new ATOM 941 N ALA B 157 7.272 9.289 0.440 1.00 34.31 N ATOM 942 CA ALA B 157 7.418 8.031 1.160 1.00 21.21 C ATOM 943 C ALA B 157 6.358 7.896 2.249 1.00 34.11 C ATOM 944 O ALA B 157 5.705 6.860 2.368 1.00 10.45 O ATOM 945 CB ALA B 157 8.811 7.925 1.761 1.00 61.34 C ATOM 0 H ALA B 157 8.061 9.927 0.542 1.00 34.31 H new ATOM 0 HA ALA B 157 7.278 7.216 0.450 1.00 21.21 H new ATOM 0 HB1 ALA B 157 8.906 6.980 2.296 1.00 61.34 H new ATOM 0 HB2 ALA B 157 9.555 7.968 0.965 1.00 61.34 H new ATOM 0 HB3 ALA B 157 8.973 8.751 2.453 1.00 61.34 H new ATOM 951 N VAL B 158 6.193 8.951 3.041 1.00 63.52 N ATOM 952 CA VAL B 158 5.213 8.951 4.120 1.00 24.32 C ATOM 953 C VAL B 158 3.823 8.603 3.600 1.00 35.24 C ATOM 954 O VAL B 158 3.106 7.801 4.198 1.00 12.14 O ATOM 955 CB VAL B 158 5.157 10.317 4.828 1.00 4.21 C ATOM 956 CG1 VAL B 158 4.064 10.326 5.887 1.00 3.02 C ATOM 957 CG2 VAL B 158 6.507 10.654 5.442 1.00 25.31 C ATOM 0 H VAL B 158 6.726 9.817 2.955 1.00 63.52 H new ATOM 0 HA VAL B 158 5.531 8.192 4.835 1.00 24.32 H new ATOM 0 HB VAL B 158 4.919 11.081 4.088 1.00 4.21 H new ATOM 0 HG11 VAL B 158 4.040 11.300 6.377 1.00 3.02 H new ATOM 0 HG12 VAL B 158 3.100 10.132 5.417 1.00 3.02 H new ATOM 0 HG13 VAL B 158 4.268 9.553 6.627 1.00 3.02 H new ATOM 0 HG21 VAL B 158 6.449 11.623 5.938 1.00 25.31 H new ATOM 0 HG22 VAL B 158 6.777 9.889 6.170 1.00 25.31 H new ATOM 0 HG23 VAL B 158 7.264 10.692 4.658 1.00 25.31 H new ATOM 967 N VAL B 159 3.447 9.213 2.480 1.00 34.53 N ATOM 968 CA VAL B 159 2.143 8.967 1.876 1.00 75.41 C ATOM 969 C VAL B 159 1.977 7.499 1.504 1.00 34.34 C ATOM 970 O VAL B 159 0.965 6.877 1.821 1.00 12.42 O ATOM 971 CB VAL B 159 1.935 9.831 0.617 1.00 63.41 C ATOM 972 CG1 VAL B 159 0.606 9.502 -0.044 1.00 3.04 C ATOM 973 CG2 VAL B 159 2.014 11.309 0.967 1.00 52.04 C ATOM 0 H VAL B 159 4.027 9.881 1.973 1.00 34.53 H new ATOM 0 HA VAL B 159 1.394 9.237 2.621 1.00 75.41 H new ATOM 0 HB VAL B 159 2.731 9.605 -0.092 1.00 63.41 H new ATOM 0 HG11 VAL B 159 0.477 10.122 -0.931 1.00 3.04 H new ATOM 0 HG12 VAL B 159 0.593 8.451 -0.331 1.00 3.04 H new ATOM 0 HG13 VAL B 159 -0.207 9.697 0.656 1.00 3.04 H new ATOM 0 HG21 VAL B 159 1.865 11.905 0.066 1.00 52.04 H new ATOM 0 HG22 VAL B 159 1.240 11.552 1.695 1.00 52.04 H new ATOM 0 HG23 VAL B 159 2.994 11.531 1.391 1.00 52.04 H new ATOM 983 N GLY B 160 2.982 6.947 0.827 1.00 52.54 N ATOM 984 CA GLY B 160 2.928 5.555 0.422 1.00 12.31 C ATOM 985 C GLY B 160 2.852 4.611 1.605 1.00 10.12 C ATOM 986 O GLY B 160 2.029 3.695 1.624 1.00 22.40 O ATOM 0 H GLY B 160 3.832 7.440 0.553 1.00 52.54 H new ATOM 0 HA2 GLY B 160 2.061 5.400 -0.219 1.00 12.31 H new ATOM 0 HA3 GLY B 160 3.810 5.318 -0.172 1.00 12.31 H new ATOM 990 N ILE B 161 3.711 4.832 2.594 1.00 60.41 N ATOM 991 CA ILE B 161 3.739 3.993 3.785 1.00 24.13 C ATOM 992 C ILE B 161 2.457 4.148 4.595 1.00 3.43 C ATOM 993 O ILE B 161 2.017 3.213 5.267 1.00 52.43 O ATOM 994 CB ILE B 161 4.944 4.328 4.683 1.00 34.21 C ATOM 995 CG1 ILE B 161 6.251 4.148 3.908 1.00 14.44 C ATOM 996 CG2 ILE B 161 4.936 3.454 5.928 1.00 41.32 C ATOM 997 CD1 ILE B 161 7.471 4.636 4.658 1.00 15.50 C ATOM 0 H ILE B 161 4.398 5.586 2.594 1.00 60.41 H new ATOM 0 HA ILE B 161 3.828 2.962 3.443 1.00 24.13 H new ATOM 0 HB ILE B 161 4.868 5.370 4.994 1.00 34.21 H new ATOM 0 HG12 ILE B 161 6.380 3.092 3.669 1.00 14.44 H new ATOM 0 HG13 ILE B 161 6.179 4.683 2.961 1.00 14.44 H new ATOM 0 HG21 ILE B 161 5.794 3.703 6.553 1.00 41.32 H new ATOM 0 HG22 ILE B 161 4.017 3.627 6.488 1.00 41.32 H new ATOM 0 HG23 ILE B 161 4.991 2.405 5.637 1.00 41.32 H new ATOM 0 HD11 ILE B 161 8.361 4.477 4.048 1.00 15.50 H new ATOM 0 HD12 ILE B 161 7.364 5.699 4.874 1.00 15.50 H new ATOM 0 HD13 ILE B 161 7.568 4.084 5.593 1.00 15.50 H new ATOM 1009 N LEU B 162 1.859 5.332 4.526 1.00 13.32 N ATOM 1010 CA LEU B 162 0.624 5.610 5.252 1.00 25.42 C ATOM 1011 C LEU B 162 -0.548 4.842 4.648 1.00 71.41 C ATOM 1012 O LEU B 162 -1.346 4.239 5.367 1.00 60.04 O ATOM 1013 CB LEU B 162 0.328 7.110 5.237 1.00 2.02 C ATOM 1014 CG LEU B 162 -0.854 7.569 6.093 1.00 60.41 C ATOM 1015 CD1 LEU B 162 -0.392 8.554 7.156 1.00 11.32 C ATOM 1016 CD2 LEU B 162 -1.935 8.191 5.221 1.00 73.34 C ATOM 0 H LEU B 162 2.209 6.115 3.975 1.00 13.32 H new ATOM 0 HA LEU B 162 0.756 5.282 6.283 1.00 25.42 H new ATOM 0 HB2 LEU B 162 1.220 7.640 5.571 1.00 2.02 H new ATOM 0 HB3 LEU B 162 0.144 7.414 4.206 1.00 2.02 H new ATOM 0 HG LEU B 162 -1.276 6.697 6.593 1.00 60.41 H new ATOM 0 HD11 LEU B 162 -1.246 8.870 7.755 1.00 11.32 H new ATOM 0 HD12 LEU B 162 0.346 8.075 7.800 1.00 11.32 H new ATOM 0 HD13 LEU B 162 0.056 9.424 6.676 1.00 11.32 H new ATOM 0 HD21 LEU B 162 -2.768 8.512 5.847 1.00 73.34 H new ATOM 0 HD22 LEU B 162 -1.526 9.052 4.693 1.00 73.34 H new ATOM 0 HD23 LEU B 162 -2.287 7.455 4.498 1.00 73.34 H new ATOM 1028 N LEU B 163 -0.643 4.866 3.324 1.00 33.54 N ATOM 1029 CA LEU B 163 -1.716 4.170 2.621 1.00 44.31 C ATOM 1030 C LEU B 163 -1.615 2.662 2.830 1.00 50.40 C ATOM 1031 O LEU B 163 -2.627 1.975 2.969 1.00 61.04 O ATOM 1032 CB LEU B 163 -1.668 4.495 1.127 1.00 2.43 C ATOM 1033 CG LEU B 163 -3.020 4.594 0.419 1.00 52.10 C ATOM 1034 CD1 LEU B 163 -3.730 5.883 0.802 1.00 41.14 C ATOM 1035 CD2 LEU B 163 -2.840 4.512 -1.089 1.00 20.42 C ATOM 0 H LEU B 163 0.009 5.360 2.715 1.00 33.54 H new ATOM 0 HA LEU B 163 -2.667 4.511 3.030 1.00 44.31 H new ATOM 0 HB2 LEU B 163 -1.142 5.441 0.998 1.00 2.43 H new ATOM 0 HB3 LEU B 163 -1.074 3.730 0.628 1.00 2.43 H new ATOM 0 HG LEU B 163 -3.637 3.754 0.738 1.00 52.10 H new ATOM 0 HD11 LEU B 163 -4.690 5.936 0.289 1.00 41.14 H new ATOM 0 HD12 LEU B 163 -3.893 5.902 1.880 1.00 41.14 H new ATOM 0 HD13 LEU B 163 -3.116 6.736 0.513 1.00 41.14 H new ATOM 0 HD21 LEU B 163 -3.813 4.584 -1.576 1.00 20.42 H new ATOM 0 HD22 LEU B 163 -2.204 5.331 -1.425 1.00 20.42 H new ATOM 0 HD23 LEU B 163 -2.374 3.562 -1.349 1.00 20.42 H new ATOM 1047 N VAL B 164 -0.386 2.154 2.852 1.00 11.44 N ATOM 1048 CA VAL B 164 -0.153 0.729 3.047 1.00 33.32 C ATOM 1049 C VAL B 164 -0.657 0.270 4.411 1.00 0.53 C ATOM 1050 O VAL B 164 -1.485 -0.636 4.506 1.00 42.23 O ATOM 1051 CB VAL B 164 1.342 0.383 2.922 1.00 63.42 C ATOM 1052 CG1 VAL B 164 1.570 -1.102 3.160 1.00 44.51 C ATOM 1053 CG2 VAL B 164 1.873 0.800 1.559 1.00 71.43 C ATOM 0 H VAL B 164 0.462 2.709 2.737 1.00 11.44 H new ATOM 0 HA VAL B 164 -0.706 0.209 2.265 1.00 33.32 H new ATOM 0 HB VAL B 164 1.889 0.936 3.685 1.00 63.42 H new ATOM 0 HG11 VAL B 164 2.633 -1.326 3.067 1.00 44.51 H new ATOM 0 HG12 VAL B 164 1.229 -1.367 4.161 1.00 44.51 H new ATOM 0 HG13 VAL B 164 1.012 -1.679 2.422 1.00 44.51 H new ATOM 0 HG21 VAL B 164 2.931 0.548 1.488 1.00 71.43 H new ATOM 0 HG22 VAL B 164 1.322 0.276 0.778 1.00 71.43 H new ATOM 0 HG23 VAL B 164 1.747 1.875 1.433 1.00 71.43 H new ATOM 1063 N VAL B 165 -0.152 0.903 5.466 1.00 12.34 N ATOM 1064 CA VAL B 165 -0.552 0.561 6.825 1.00 10.11 C ATOM 1065 C VAL B 165 -2.070 0.574 6.971 1.00 70.32 C ATOM 1066 O VAL B 165 -2.663 -0.375 7.482 1.00 22.33 O ATOM 1067 CB VAL B 165 0.060 1.534 7.851 1.00 23.32 C ATOM 1068 CG1 VAL B 165 -0.389 1.176 9.260 1.00 22.32 C ATOM 1069 CG2 VAL B 165 1.578 1.529 7.749 1.00 12.20 C ATOM 0 H VAL B 165 0.535 1.655 5.405 1.00 12.34 H new ATOM 0 HA VAL B 165 -0.180 -0.445 7.021 1.00 10.11 H new ATOM 0 HB VAL B 165 -0.293 2.541 7.628 1.00 23.32 H new ATOM 0 HG11 VAL B 165 0.053 1.874 9.971 1.00 22.32 H new ATOM 0 HG12 VAL B 165 -1.476 1.235 9.322 1.00 22.32 H new ATOM 0 HG13 VAL B 165 -0.066 0.162 9.498 1.00 22.32 H new ATOM 0 HG21 VAL B 165 1.994 2.222 8.481 1.00 12.20 H new ATOM 0 HG22 VAL B 165 1.953 0.525 7.946 1.00 12.20 H new ATOM 0 HG23 VAL B 165 1.876 1.837 6.747 1.00 12.20 H new ATOM 1079 N VAL B 166 -2.692 1.658 6.519 1.00 44.43 N ATOM 1080 CA VAL B 166 -4.142 1.795 6.598 1.00 60.03 C ATOM 1081 C VAL B 166 -4.842 0.622 5.922 1.00 51.22 C ATOM 1082 O VAL B 166 -5.865 0.133 6.405 1.00 14.10 O ATOM 1083 CB VAL B 166 -4.618 3.108 5.947 1.00 23.30 C ATOM 1084 CG1 VAL B 166 -6.134 3.216 6.011 1.00 72.41 C ATOM 1085 CG2 VAL B 166 -3.961 4.303 6.619 1.00 75.35 C ATOM 0 H VAL B 166 -2.215 2.454 6.095 1.00 44.43 H new ATOM 0 HA VAL B 166 -4.402 1.808 7.656 1.00 60.03 H new ATOM 0 HB VAL B 166 -4.322 3.102 4.898 1.00 23.30 H new ATOM 0 HG11 VAL B 166 -6.452 4.149 5.547 1.00 72.41 H new ATOM 0 HG12 VAL B 166 -6.581 2.376 5.480 1.00 72.41 H new ATOM 0 HG13 VAL B 166 -6.456 3.200 7.052 1.00 72.41 H new ATOM 0 HG21 VAL B 166 -4.308 5.222 6.147 1.00 75.35 H new ATOM 0 HG22 VAL B 166 -4.225 4.316 7.677 1.00 75.35 H new ATOM 0 HG23 VAL B 166 -2.878 4.229 6.516 1.00 75.35 H new ATOM 1095 N LEU B 167 -4.286 0.173 4.803 1.00 75.20 N ATOM 1096 CA LEU B 167 -4.857 -0.944 4.058 1.00 64.34 C ATOM 1097 C LEU B 167 -4.810 -2.227 4.882 1.00 65.21 C ATOM 1098 O LEU B 167 -5.812 -2.928 5.016 1.00 24.42 O ATOM 1099 CB LEU B 167 -4.105 -1.142 2.741 1.00 23.34 C ATOM 1100 CG LEU B 167 -4.929 -1.683 1.572 1.00 3.42 C ATOM 1101 CD1 LEU B 167 -5.627 -2.976 1.964 1.00 52.11 C ATOM 1102 CD2 LEU B 167 -5.943 -0.646 1.111 1.00 52.23 C ATOM 0 H LEU B 167 -3.440 0.565 4.391 1.00 75.20 H new ATOM 0 HA LEU B 167 -5.899 -0.710 3.842 1.00 64.34 H new ATOM 0 HB2 LEU B 167 -3.675 -0.185 2.444 1.00 23.34 H new ATOM 0 HB3 LEU B 167 -3.274 -1.824 2.920 1.00 23.34 H new ATOM 0 HG LEU B 167 -4.254 -1.896 0.743 1.00 3.42 H new ATOM 0 HD11 LEU B 167 -6.209 -3.346 1.120 1.00 52.11 H new ATOM 0 HD12 LEU B 167 -4.882 -3.720 2.246 1.00 52.11 H new ATOM 0 HD13 LEU B 167 -6.291 -2.790 2.808 1.00 52.11 H new ATOM 0 HD21 LEU B 167 -6.521 -1.047 0.279 1.00 52.23 H new ATOM 0 HD22 LEU B 167 -6.614 -0.402 1.935 1.00 52.23 H new ATOM 0 HD23 LEU B 167 -5.421 0.255 0.789 1.00 52.23 H new ATOM 1114 N GLY B 168 -3.638 -2.528 5.435 1.00 51.15 N ATOM 1115 CA GLY B 168 -3.482 -3.724 6.240 1.00 2.41 C ATOM 1116 C GLY B 168 -4.470 -3.782 7.390 1.00 72.34 C ATOM 1117 O GLY B 168 -5.076 -4.822 7.645 1.00 0.33 O ATOM 0 H GLY B 168 -2.794 -1.964 5.339 1.00 51.15 H new ATOM 0 HA2 GLY B 168 -3.612 -4.603 5.609 1.00 2.41 H new ATOM 0 HA3 GLY B 168 -2.467 -3.763 6.635 1.00 2.41 H new ATOM 1121 N VAL B 169 -4.630 -2.661 8.087 1.00 25.30 N ATOM 1122 CA VAL B 169 -5.549 -2.588 9.216 1.00 5.22 C ATOM 1123 C VAL B 169 -6.974 -2.919 8.786 1.00 23.40 C ATOM 1124 O VAL B 169 -7.651 -3.731 9.417 1.00 3.21 O ATOM 1125 CB VAL B 169 -5.531 -1.191 9.865 1.00 4.12 C ATOM 1126 CG1 VAL B 169 -6.541 -1.117 11.000 1.00 3.14 C ATOM 1127 CG2 VAL B 169 -4.134 -0.852 10.360 1.00 3.24 C ATOM 0 H VAL B 169 -4.135 -1.791 7.889 1.00 25.30 H new ATOM 0 HA VAL B 169 -5.213 -3.324 9.947 1.00 5.22 H new ATOM 0 HB VAL B 169 -5.813 -0.455 9.112 1.00 4.12 H new ATOM 0 HG11 VAL B 169 -6.514 -0.123 11.447 1.00 3.14 H new ATOM 0 HG12 VAL B 169 -7.540 -1.313 10.611 1.00 3.14 H new ATOM 0 HG13 VAL B 169 -6.293 -1.861 11.757 1.00 3.14 H new ATOM 0 HG21 VAL B 169 -4.140 0.138 10.816 1.00 3.24 H new ATOM 0 HG22 VAL B 169 -3.821 -1.590 11.099 1.00 3.24 H new ATOM 0 HG23 VAL B 169 -3.438 -0.861 9.521 1.00 3.24 H new ATOM 1137 N VAL B 170 -7.423 -2.286 7.708 1.00 74.12 N ATOM 1138 CA VAL B 170 -8.768 -2.514 7.192 1.00 71.41 C ATOM 1139 C VAL B 170 -8.971 -3.977 6.815 1.00 14.32 C ATOM 1140 O VAL B 170 -9.913 -4.623 7.275 1.00 74.32 O ATOM 1141 CB VAL B 170 -9.052 -1.634 5.960 1.00 10.22 C ATOM 1142 CG1 VAL B 170 -10.488 -1.820 5.492 1.00 33.03 C ATOM 1143 CG2 VAL B 170 -8.771 -0.172 6.273 1.00 63.14 C ATOM 0 H VAL B 170 -6.875 -1.611 7.174 1.00 74.12 H new ATOM 0 HA VAL B 170 -9.463 -2.247 7.989 1.00 71.41 H new ATOM 0 HB VAL B 170 -8.388 -1.943 5.153 1.00 10.22 H new ATOM 0 HG11 VAL B 170 -10.671 -1.191 4.621 1.00 33.03 H new ATOM 0 HG12 VAL B 170 -10.652 -2.864 5.226 1.00 33.03 H new ATOM 0 HG13 VAL B 170 -11.171 -1.538 6.293 1.00 33.03 H new ATOM 0 HG21 VAL B 170 -8.977 0.435 5.391 1.00 63.14 H new ATOM 0 HG22 VAL B 170 -9.409 0.153 7.095 1.00 63.14 H new ATOM 0 HG23 VAL B 170 -7.725 -0.055 6.558 1.00 63.14 H new ATOM 1153 N PHE B 171 -8.081 -4.496 5.976 1.00 74.51 N ATOM 1154 CA PHE B 171 -8.162 -5.884 5.536 1.00 50.25 C ATOM 1155 C PHE B 171 -8.241 -6.829 6.731 1.00 71.31 C ATOM 1156 O PHE B 171 -9.149 -7.654 6.825 1.00 50.33 O ATOM 1157 CB PHE B 171 -6.952 -6.239 4.669 1.00 52.34 C ATOM 1158 CG PHE B 171 -7.181 -7.426 3.779 1.00 32.42 C ATOM 1159 CD1 PHE B 171 -8.300 -7.493 2.966 1.00 34.24 C ATOM 1160 CD2 PHE B 171 -6.275 -8.475 3.754 1.00 53.04 C ATOM 1161 CE1 PHE B 171 -8.512 -8.586 2.145 1.00 41.52 C ATOM 1162 CE2 PHE B 171 -6.482 -9.569 2.935 1.00 43.32 C ATOM 1163 CZ PHE B 171 -7.601 -9.624 2.129 1.00 1.22 C ATOM 0 H PHE B 171 -7.295 -3.976 5.587 1.00 74.51 H new ATOM 0 HA PHE B 171 -9.070 -5.999 4.944 1.00 50.25 H new ATOM 0 HB2 PHE B 171 -6.691 -5.378 4.053 1.00 52.34 H new ATOM 0 HB3 PHE B 171 -6.098 -6.439 5.316 1.00 52.34 H new ATOM 0 HD1 PHE B 171 -9.015 -6.683 2.973 1.00 34.24 H new ATOM 0 HD2 PHE B 171 -5.397 -8.437 4.382 1.00 53.04 H new ATOM 0 HE1 PHE B 171 -9.390 -8.628 1.517 1.00 41.52 H new ATOM 0 HE2 PHE B 171 -5.769 -10.380 2.926 1.00 43.32 H new ATOM 0 HZ PHE B 171 -7.764 -10.477 1.487 1.00 1.22 H new ATOM 1173 N GLY B 172 -7.281 -6.702 7.643 1.00 13.04 N ATOM 1174 CA GLY B 172 -7.259 -7.551 8.820 1.00 11.01 C ATOM 1175 C GLY B 172 -8.580 -7.544 9.565 1.00 11.03 C ATOM 1176 O GLY B 172 -9.196 -8.593 9.758 1.00 54.21 O ATOM 0 H GLY B 172 -6.519 -6.027 7.587 1.00 13.04 H new ATOM 0 HA2 GLY B 172 -7.018 -8.572 8.523 1.00 11.01 H new ATOM 0 HA3 GLY B 172 -6.466 -7.218 9.490 1.00 11.01 H new ATOM 1180 N ILE B 173 -9.014 -6.361 9.984 1.00 50.40 N ATOM 1181 CA ILE B 173 -10.270 -6.223 10.712 1.00 70.42 C ATOM 1182 C ILE B 173 -11.440 -6.763 9.897 1.00 25.41 C ATOM 1183 O ILE B 173 -12.340 -7.409 10.436 1.00 14.32 O ATOM 1184 CB ILE B 173 -10.549 -4.754 11.079 1.00 44.11 C ATOM 1185 CG1 ILE B 173 -9.409 -4.193 11.931 1.00 54.33 C ATOM 1186 CG2 ILE B 173 -11.875 -4.635 11.815 1.00 44.33 C ATOM 1187 CD1 ILE B 173 -9.437 -2.685 12.061 1.00 4.41 C ATOM 0 H ILE B 173 -8.515 -5.484 9.832 1.00 50.40 H new ATOM 0 HA ILE B 173 -10.169 -6.805 11.628 1.00 70.42 H new ATOM 0 HB ILE B 173 -10.612 -4.171 10.160 1.00 44.11 H new ATOM 0 HG12 ILE B 173 -9.457 -4.636 12.926 1.00 54.33 H new ATOM 0 HG13 ILE B 173 -8.457 -4.494 11.494 1.00 54.33 H new ATOM 0 HG21 ILE B 173 -12.058 -3.591 12.068 1.00 44.33 H new ATOM 0 HG22 ILE B 173 -12.679 -5.001 11.177 1.00 44.33 H new ATOM 0 HG23 ILE B 173 -11.839 -5.228 12.729 1.00 44.33 H new ATOM 0 HD11 ILE B 173 -8.600 -2.357 12.678 1.00 4.41 H new ATOM 0 HD12 ILE B 173 -9.358 -2.233 11.072 1.00 4.41 H new ATOM 0 HD13 ILE B 173 -10.373 -2.377 12.526 1.00 4.41 H new ATOM 1199 N LEU B 174 -11.421 -6.497 8.596 1.00 53.45 N ATOM 1200 CA LEU B 174 -12.479 -6.957 7.704 1.00 4.31 C ATOM 1201 C LEU B 174 -12.610 -8.476 7.754 1.00 33.34 C ATOM 1202 O LEU B 174 -13.673 -9.008 8.076 1.00 62.15 O ATOM 1203 CB LEU B 174 -12.200 -6.504 6.271 1.00 73.42 C ATOM 1204 CG LEU B 174 -12.617 -5.073 5.925 1.00 23.23 C ATOM 1205 CD1 LEU B 174 -12.235 -4.738 4.492 1.00 71.12 C ATOM 1206 CD2 LEU B 174 -14.113 -4.889 6.138 1.00 31.30 C ATOM 0 H LEU B 174 -10.683 -5.964 8.135 1.00 53.45 H new ATOM 0 HA LEU B 174 -13.419 -6.518 8.039 1.00 4.31 H new ATOM 0 HB2 LEU B 174 -11.132 -6.606 6.081 1.00 73.42 H new ATOM 0 HB3 LEU B 174 -12.711 -7.185 5.590 1.00 73.42 H new ATOM 0 HG LEU B 174 -12.088 -4.389 6.589 1.00 23.23 H new ATOM 0 HD11 LEU B 174 -12.539 -3.717 4.264 1.00 71.12 H new ATOM 0 HD12 LEU B 174 -11.156 -4.830 4.372 1.00 71.12 H new ATOM 0 HD13 LEU B 174 -12.736 -5.427 3.811 1.00 71.12 H new ATOM 0 HD21 LEU B 174 -14.393 -3.866 5.887 1.00 31.30 H new ATOM 0 HD22 LEU B 174 -14.660 -5.582 5.498 1.00 31.30 H new ATOM 0 HD23 LEU B 174 -14.359 -5.087 7.181 1.00 31.30 H new ATOM 1218 N ILE B 175 -11.522 -9.168 7.434 1.00 32.14 N ATOM 1219 CA ILE B 175 -11.515 -10.626 7.443 1.00 63.25 C ATOM 1220 C ILE B 175 -11.849 -11.168 8.830 1.00 73.24 C ATOM 1221 O ILE B 175 -12.445 -12.236 8.964 1.00 24.02 O ATOM 1222 CB ILE B 175 -10.149 -11.185 7.002 1.00 72.14 C ATOM 1223 CG1 ILE B 175 -9.763 -10.625 5.631 1.00 24.33 C ATOM 1224 CG2 ILE B 175 -10.184 -12.706 6.969 1.00 51.45 C ATOM 1225 CD1 ILE B 175 -8.338 -10.936 5.231 1.00 14.13 C ATOM 0 H ILE B 175 -10.634 -8.743 7.165 1.00 32.14 H new ATOM 0 HA ILE B 175 -12.277 -10.950 6.734 1.00 63.25 H new ATOM 0 HB ILE B 175 -9.395 -10.875 7.726 1.00 72.14 H new ATOM 0 HG12 ILE B 175 -10.440 -11.030 4.878 1.00 24.33 H new ATOM 0 HG13 ILE B 175 -9.903 -9.544 5.637 1.00 24.33 H new ATOM 0 HG21 ILE B 175 -9.212 -13.086 6.656 1.00 51.45 H new ATOM 0 HG22 ILE B 175 -10.419 -13.086 7.963 1.00 51.45 H new ATOM 0 HG23 ILE B 175 -10.947 -13.037 6.265 1.00 51.45 H new ATOM 0 HD11 ILE B 175 -8.134 -10.509 4.249 1.00 14.13 H new ATOM 0 HD12 ILE B 175 -7.653 -10.507 5.963 1.00 14.13 H new ATOM 0 HD13 ILE B 175 -8.198 -12.016 5.193 1.00 14.13 H new ATOM 1237 N LYS B 176 -11.462 -10.422 9.859 1.00 12.02 N ATOM 1238 CA LYS B 176 -11.722 -10.823 11.236 1.00 25.33 C ATOM 1239 C LYS B 176 -13.216 -10.783 11.542 1.00 54.31 C ATOM 1240 O LYS B 176 -13.782 -11.752 12.049 1.00 54.31 O ATOM 1241 CB LYS B 176 -10.968 -9.912 12.207 1.00 52.12 C ATOM 1242 CG LYS B 176 -9.704 -10.538 12.771 1.00 73.22 C ATOM 1243 CD LYS B 176 -8.677 -9.481 13.143 1.00 4.30 C ATOM 1244 CE LYS B 176 -7.260 -9.956 12.860 1.00 33.05 C ATOM 1245 NZ LYS B 176 -6.450 -10.061 14.104 1.00 44.24 N ATOM 0 H LYS B 176 -10.967 -9.535 9.765 1.00 12.02 H new ATOM 0 HA LYS B 176 -11.370 -11.847 11.361 1.00 25.33 H new ATOM 0 HB2 LYS B 176 -10.707 -8.986 11.695 1.00 52.12 H new ATOM 0 HB3 LYS B 176 -11.630 -9.646 13.031 1.00 52.12 H new ATOM 0 HG2 LYS B 176 -9.952 -11.131 13.651 1.00 73.22 H new ATOM 0 HG3 LYS B 176 -9.276 -11.220 12.037 1.00 73.22 H new ATOM 0 HD2 LYS B 176 -8.874 -8.567 12.582 1.00 4.30 H new ATOM 0 HD3 LYS B 176 -8.775 -9.234 14.200 1.00 4.30 H new ATOM 0 HE2 LYS B 176 -7.295 -10.927 12.367 1.00 33.05 H new ATOM 0 HE3 LYS B 176 -6.777 -9.265 12.170 1.00 33.05 H new ATOM 0 HZ1 LYS B 176 -5.491 -10.388 13.868 1.00 44.24 H new ATOM 0 HZ2 LYS B 176 -6.395 -9.129 14.562 1.00 44.24 H new ATOM 0 HZ3 LYS B 176 -6.897 -10.740 14.753 1.00 44.24 H new ATOM 1259 N ARG B 177 -13.849 -9.657 11.228 1.00 4.15 N ATOM 1260 CA ARG B 177 -15.277 -9.491 11.469 1.00 10.11 C ATOM 1261 C ARG B 177 -16.089 -10.470 10.625 1.00 75.42 C ATOM 1262 O ARG B 177 -17.012 -11.116 11.120 1.00 64.31 O ATOM 1263 CB ARG B 177 -15.706 -8.056 11.157 1.00 53.12 C ATOM 1264 CG ARG B 177 -15.779 -7.162 12.385 1.00 21.31 C ATOM 1265 CD ARG B 177 -16.997 -7.484 13.237 1.00 33.42 C ATOM 1266 NE ARG B 177 -18.236 -7.024 12.616 1.00 31.10 N ATOM 1267 CZ ARG B 177 -19.379 -6.879 13.277 1.00 73.22 C ATOM 1268 NH1 ARG B 177 -19.440 -7.157 14.571 1.00 23.42 N ATOM 1269 NH2 ARG B 177 -20.464 -6.454 12.641 1.00 24.14 N ATOM 0 H ARG B 177 -13.395 -8.847 10.806 1.00 4.15 H new ATOM 0 HA ARG B 177 -15.468 -9.700 12.522 1.00 10.11 H new ATOM 0 HB2 ARG B 177 -15.005 -7.623 10.444 1.00 53.12 H new ATOM 0 HB3 ARG B 177 -16.682 -8.075 10.673 1.00 53.12 H new ATOM 0 HG2 ARG B 177 -14.874 -7.285 12.980 1.00 21.31 H new ATOM 0 HG3 ARG B 177 -15.817 -6.118 12.075 1.00 21.31 H new ATOM 0 HD2 ARG B 177 -17.051 -8.560 13.400 1.00 33.42 H new ATOM 0 HD3 ARG B 177 -16.888 -7.018 14.216 1.00 33.42 H new ATOM 0 HE ARG B 177 -18.223 -6.802 11.621 1.00 31.10 H new ATOM 0 HH11 ARG B 177 -18.608 -7.483 15.062 1.00 23.42 H new ATOM 0 HH12 ARG B 177 -20.319 -7.045 15.076 1.00 23.42 H new ATOM 0 HH21 ARG B 177 -20.420 -6.239 11.645 1.00 24.14 H new ATOM 0 HH22 ARG B 177 -21.342 -6.343 13.148 1.00 24.14 H new